4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide

C11H9FN2O2S — CID 103829649

IUPAC4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2ccc(F)cc2O)s1
InChIInChI=1S/C11H9FN2O2S/c1-6-5-13-11(17-6)14-10(16)8-3-2-7(12)4-9(8)15/h2-5,15H,1H3,(H,13,14,16)
InChIKeyFRDGZAKQUHSARE-UHFFFAOYSA-N
MW252.27 g/mol
LogP2.55
Rot. Bonds2

About 4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide

4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 103829649) has the molecular formula C11H9FN2O2S and a molecular weight of 252.27 g/mol. Its IUPAC name is 4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID103829649
Molecular FormulaC11H9FN2O2S
Molecular Weight252.27 g/mol
Exact Mass252.04
IUPAC Name4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1cnc(NC(=O)c2ccc(F)cc2O)s1
InChIInChI=1S/C11H9FN2O2S/c1-6-5-13-11(17-6)14-10(16)8-3-2-7(12)4-9(8)15/h2-5,15H,1H3,(H,13,14,16)
InChIKeyFRDGZAKQUHSARE-UHFFFAOYSA-N
XLogP2.55
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide
CID 53309399
4-bromo-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 47435879
2-fluoro-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 79770175
5-fluoro-N-(5-methyl-1,3-thiazol-2-yl)-2-nitrobenzamide
CID 51889946
4-fluoro-2-(4-hydroxybut-1-ynyl)-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 60815511
2-hydroxy-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-4-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;2-hydroxy-5-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide;tris(2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide)
CID 167706906
4-fluoro-3-methyl-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 63212388
2-methoxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 803477
4-fluoro-2-hydroxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 103829678
N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]-2-hydroxy-4-methoxybenzamide
CID 55438043
2-chloro-N-(5-methyl-1,3-thiazol-2-yl)-5-sulfanylbenzamide
CID 107021003
N-(5-methyl-1,3-thiazol-2-yl)-2-(trifluoromethyl)benzamide
CID 4813517

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide (CID 103829649) is 4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide is Cc1cnc(NC(=O)c2ccc(F)cc2O)s1.
What is the InChIKey of 4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is FRDGZAKQUHSARE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O2S/c1-6-5-13-11(17-6)14-10(16)8-3-2-7(12)4-9(8)15/h2-5,15H,1H3,(H,13,14,16).
What are the key properties of 4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide?
4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 252.27 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 103829649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).